ethyl 1-[4-({[4-(morpholin-4-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)benzoyl]piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-[4-({[4-(morpholin-4-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)benzoyl]piperidine-4-carboxylate
ethyl 1-[4-({[4-(morpholin-4-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)benzoyl]piperidine-4-carboxylate
Compound characteristics
| Compound ID: | V026-6139 |
| Compound Name: | ethyl 1-[4-({[4-(morpholin-4-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)benzoyl]piperidine-4-carboxylate |
| Molecular Weight: | 538.59 |
| Molecular Formula: | C25 H29 F3 N4 O4 S |
| Salt: | not_available |
| Smiles: | CCOC(C1CCN(CC1)C(c1ccc(CSc2nc(cc(n2)N2CCOCC2)C(F)(F)F)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.935 |
| logD: | 3.935 |
| logSw: | -3.8794 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.487 |
| InChI Key: | KZSQQVPKRMLLHT-UHFFFAOYSA-N |